#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lud s ALA 2 N 0.00 1.17 -0.14 2.41 0.00 -0.27 0.14 121.76 125.07 1lud s ALA 2 Ca 0.00 -1.20 -0.06 0.00 0.00 0.00 0.00 51.96 50.71 1lud s ALA 2 Cb 0.00 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 1lud s ALA 2 CO 0.00 -0.01 0.06 -0.06 0.00 0.00 0.00 175.76 175.75 1lud s PHE 3 N -2.36 3.29 -0.41 0.00 0.40 0.20 0.17 117.98 119.26 1lud s PHE 3 Ca 0.06 0.19 0.02 0.00 -0.60 0.00 0.00 56.93 56.59 1lud s PHE 3 Cb -0.03 -1.97 0.14 0.00 0.51 0.00 0.00 43.02 41.67 1lud s PHE 3 CO 0.01 0.35 0.23 -1.17 0.70 0.00 0.00 175.22 175.34 1lud s LEU 4 N -0.26 2.19 0.01 -0.37 2.96 -0.90 0.11 118.68 122.43 1lud s LEU 4 Ca 0.08 -2.51 0.02 0.00 -0.22 0.00 0.00 54.13 51.50 1lud s LEU 4 Cb -0.12 -0.85 -0.01 0.00 0.50 0.00 0.00 46.19 45.71 1lud s LEU 4 CO 0.02 -0.28 -0.07 -1.66 -1.32 0.00 0.00 176.35 173.04 1lud s TRP 5 N 0.55 0.59 -0.21 5.38 -2.14 -0.83 -4.67 118.94 117.61 1lud s TRP 5 Ca 0.18 -0.22 -0.10 0.00 2.66 0.00 0.00 56.10 58.63 1lud s TRP 5 Cb -0.23 -0.37 -0.05 0.00 -3.10 0.00 0.00 33.47 29.72 1lud s TRP 5 CO 0.00 -0.03 0.12 0.00 -2.66 0.00 0.00 176.95 174.39 1lud s ALA 6 N -0.50 3.62 0.17 2.67 0.00 -1.26 -2.61 121.76 123.85 1lud s ALA 6 Ca -0.01 -0.75 0.05 0.00 0.00 0.00 0.00 51.96 51.25 1lud s ALA 6 Cb -0.05 -2.16 -0.05 0.00 0.00 0.00 0.00 23.12 20.87 1lud s ALA 6 CO 0.00 0.08 -0.10 1.14 0.00 0.00 0.00 175.76 176.88 1lud s GLN 7 N 0.52 1.15 0.00 0.00 -2.07 0.62 -4.58 119.66 115.31 1lud s GLN 7 Ca 0.07 -1.51 0.00 0.00 -1.82 0.00 0.00 55.36 52.10 1lud s GLN 7 Cb -0.12 -0.72 0.00 0.00 -1.09 0.00 0.00 33.01 31.08 1lud s GLN 7 CO -0.00 0.08 0.00 -0.40 -1.32 0.00 0.00 175.29 173.64 1lud n ASP 8 N -0.26 0.00 -0.13 12.60 5.75 -1.22 -1.28 116.55 132.01 1lud n ASP 8 Ca -0.09 -0.34 -0.08 0.00 -0.01 0.00 0.00 54.79 54.26 1lud n ASP 8 Cb 0.61 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.70 1lud n ASP 8 CO 0.00 0.00 0.00 0.08 -0.11 0.00 0.00 177.20 177.17 1lud h ARG 9 N 0.00 0.55 -0.05 0.11 -0.00 -1.58 -2.71 114.38 110.71 1lud h ARG 9 Ca 0.00 -0.05 -0.12 0.00 -0.00 0.00 0.00 59.98 59.81 1lud h ARG 9 Cb 0.00 -0.12 -0.01 0.00 -0.00 0.00 0.00 29.97 29.84 1lud h ARG 9 CO 0.00 0.41 -0.54 -0.44 -0.00 0.00 0.00 179.97 179.40 1lud h ASP 10 N 0.54 0.14 0.00 0.08 3.32 -1.91 -3.47 116.42 115.12 1lud h ASP 10 Ca 0.15 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1lud h ASP 10 Cb -0.00 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1lud h ASP 10 CO -0.03 0.66 0.00 0.61 -1.72 0.00 0.00 179.24 178.76 1lud n GLY 11 N 0.08 0.95 3.91 2.75 0.00 -1.02 -5.07 105.19 106.80 1lud n GLY 11 Ca -0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 1lud n GLY 11 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1lud s LEU 12 N 0.00 3.93 0.04 0.99 2.96 -1.26 -3.23 118.68 122.11 1lud s LEU 12 Ca 0.00 0.71 0.00 0.00 -0.22 0.00 0.00 54.13 54.62 1lud s LEU 12 Cb 0.00 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.11 1lud s LEU 12 CO 0.00 -0.33 0.00 2.30 -1.32 0.00 0.00 176.35 177.00 1lud n ILE 13 N -1.53 0.38 -3.59 6.68 -5.35 -1.15 -3.40 119.36 111.40 1lud n ILE 13 Ca -0.02 0.12 -0.17 0.00 -0.27 0.00 0.00 62.75 62.42 1lud n ILE 13 Cb 0.55 -1.12 -0.07 0.00 -1.74 0.00 0.00 39.64 37.26 1lud n ILE 13 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1lud s GLY 14 N -3.39 -0.46 -0.04 3.28 0.00 -1.24 -4.61 107.32 100.86 1lud s GLY 14 Ca 0.00 1.03 0.03 0.00 0.00 0.00 0.00 44.72 45.78 1lud s GLY 14 CO 0.00 0.71 -0.12 1.25 0.00 0.00 0.00 173.10 174.94 1lud s LYS 15 N -1.26 1.36 -2.03 2.90 2.20 -1.24 -4.08 119.74 117.60 1lud s LYS 15 Ca -0.12 -0.42 0.00 0.00 -0.36 0.00 0.00 55.97 55.07 1lud s LYS 15 Cb -0.01 -1.21 0.00 0.00 -1.51 0.00 0.00 37.83 35.10 1lud s LYS 15 CO 0.08 0.14 0.00 -0.25 -0.36 0.00 0.00 175.35 174.96 1lud n ASP 16 N 3.35 -5.73 0.00 1.43 8.00 -1.26 -3.45 116.55 118.89 1lud n ASP 16 Ca -0.19 0.27 0.00 0.00 0.71 0.00 0.00 54.79 55.57 1lud n ASP 16 Cb 0.53 -4.92 0.00 0.00 -0.02 0.00 0.00 41.12 36.72 1lud n ASP 16 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lud n GLY 17 N -0.69 2.05 3.72 0.44 0.00 -1.26 -4.96 105.19 104.49 1lud n GLY 17 Ca -0.23 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 1lud n GLY 17 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1lud s HIS 18 N 0.00 3.10 0.89 1.61 -3.43 -1.22 -4.95 115.29 111.28 1lud s HIS 18 Ca 0.00 0.72 -0.13 0.00 -0.80 0.00 0.00 55.06 54.85 1lud s HIS 18 Cb 0.00 -3.87 0.05 0.00 -1.43 0.00 0.00 32.58 27.33 1lud s HIS 18 CO 0.00 -3.16 0.70 1.28 -2.00 0.00 0.00 174.74 171.56 1lud n LEU 19 N 3.85 1.38 0.07 5.38 4.77 -1.26 -3.63 117.00 127.56 1lud n LEU 19 Ca 0.13 0.43 -0.13 0.00 -0.03 0.00 0.00 56.01 56.40 1lud n LEU 19 Cb 0.39 -1.31 -0.14 0.00 -2.33 0.00 0.00 43.42 40.04 1lud n LEU 19 CO 0.61 -2.96 -0.16 1.55 -1.33 0.00 0.00 177.39 175.11 1lud h PRO 20 N -1.34 0.17 -6.14 3.23 0.14 -1.88 -3.46 132.00 122.72 1lud h PRO 20 Ca -0.44 -0.29 -0.68 0.00 0.14 0.00 0.00 66.00 64.72 1lud h PRO 20 Cb 1.29 0.11 -0.22 0.00 0.14 0.00 0.00 31.00 32.32 1lud h PRO 20 CO 0.39 1.05 -0.74 1.67 0.14 0.00 0.00 178.00 180.51 1lud s TRP 21 N -2.65 2.80 -0.75 1.56 -2.14 -1.26 -5.06 118.94 111.45 1lud s TRP 21 Ca -0.05 -0.14 -0.18 0.00 2.66 0.00 0.00 56.10 58.38 1lud s TRP 21 Cb 0.08 -1.69 0.13 0.00 -3.10 0.00 0.00 33.47 28.89 1lud s TRP 21 CO 0.85 0.19 0.88 -1.58 -2.66 0.00 0.00 176.95 174.63 1lud s HIS 22 N -0.63 3.13 -0.27 1.66 2.46 -1.26 -4.98 115.29 115.40 1lud s HIS 22 Ca 0.09 -1.22 0.01 0.00 0.47 0.00 0.00 55.06 54.41 1lud s HIS 22 Cb -0.11 -4.10 0.08 0.00 -0.13 0.00 0.00 32.58 28.31 1lud s HIS 22 CO 0.01 -1.35 -0.01 -1.17 -2.47 0.00 0.00 174.74 169.75 1lud s LEU 23 N 2.42 3.04 0.23 8.88 2.96 -1.26 -4.98 118.68 129.98 1lud s LEU 23 Ca 0.21 -1.48 -0.01 0.00 -0.22 0.00 0.00 54.13 52.63 1lud s LEU 23 Cb -0.15 -1.25 0.25 0.00 0.50 0.00 0.00 46.19 45.55 1lud s LEU 23 CO -0.01 -0.29 1.62 1.55 -1.32 0.00 0.00 176.35 177.90 1lud h PRO 24 N 7.89 0.56 0.00 0.98 0.14 -1.98 -2.80 132.00 136.79 1lud h PRO 24 Ca -0.14 -0.27 -0.02 0.00 0.14 0.00 0.00 66.00 65.71 1lud h PRO 24 Cb 1.05 -0.01 -0.00 0.00 0.14 0.00 0.00 31.00 32.18 1lud h PRO 24 CO 0.45 0.84 -0.11 0.22 0.14 0.00 0.00 178.00 179.54 1lud h ASP 25 N 0.47 0.00 0.14 1.44 3.58 -1.96 -2.76 116.42 117.32 1lud h ASP 25 Ca 0.05 0.00 -0.19 0.00 0.42 0.00 0.00 57.03 57.31 1lud h ASP 25 Cb 0.84 0.00 0.02 0.00 1.72 0.00 0.00 39.33 41.91 1lud h ASP 25 CO 0.07 0.11 -0.87 -0.78 -2.88 0.00 0.00 179.24 174.89 1lud h ASP 26 N 0.00 0.45 -0.98 2.28 3.58 -1.91 -2.96 116.42 116.88 1lud h ASP 26 Ca -0.00 -0.94 0.12 0.00 0.42 0.00 0.00 57.03 56.63 1lud h ASP 26 Cb 0.38 -0.15 -0.09 0.00 1.72 0.00 0.00 39.33 41.20 1lud h ASP 26 CO 0.01 1.41 0.61 -0.07 -2.88 0.00 0.00 179.24 178.33 1lud h LEU 27 N -0.38 0.88 -0.79 2.28 3.38 -1.40 0.16 115.31 119.44 1lud h LEU 27 Ca -0.16 0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 1lud h LEU 27 Cb 1.64 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.25 1lud h LEU 27 CO 0.14 0.46 0.05 0.45 0.09 0.00 0.00 178.44 179.62 1lud h HIS 28 N 0.95 1.03 -0.58 1.13 3.86 -1.56 -1.54 115.15 118.43 1lud h HIS 28 Ca 0.49 -0.15 -0.06 0.00 -1.16 0.00 0.00 60.37 59.49 1lud h HIS 28 Cb 0.51 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.67 1lud h HIS 28 CO -0.01 0.90 0.10 -0.92 0.86 0.00 0.00 177.93 178.86 1lud h TYR 29 N 0.90 0.97 -0.13 2.45 3.20 -0.61 0.06 116.97 123.80 1lud h TYR 29 Ca 0.17 -0.11 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 1lud h TYR 29 Cb 0.46 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1lud h TYR 29 CO 0.03 0.82 0.01 0.35 -1.64 0.00 0.00 178.16 177.73 1lud h PHE 30 N 0.88 0.25 0.78 -3.82 3.57 -0.45 -0.50 116.94 117.64 1lud h PHE 30 Ca 0.18 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.61 1lud h PHE 30 Cb 0.37 -0.07 0.01 0.00 2.79 0.00 0.00 35.95 39.05 1lud h PHE 30 CO 0.02 0.44 -0.37 -0.09 -2.23 0.00 0.00 178.31 176.08 1lud h ARG 31 N -0.02 -1.00 -1.00 1.11 2.43 -1.11 -2.26 114.38 112.52 1lud h ARG 31 Ca 0.04 0.07 0.22 0.00 -0.81 0.00 0.00 59.98 59.50 1lud h ARG 31 Cb 0.33 0.23 -0.11 0.00 -0.42 0.00 0.00 29.97 30.01 1lud h ARG 31 CO 0.00 -0.67 0.62 0.00 -1.51 0.00 0.00 179.97 178.41 1lud h ALA 32 N -1.31 1.87 0.00 2.80 0.00 -1.05 0.44 119.26 122.01 1lud h ALA 32 Ca -0.11 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1lud h ALA 32 Cb 0.80 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1lud h ALA 32 CO 0.18 -0.28 0.00 1.96 0.00 0.00 0.00 179.25 181.11 1lud h GLN 33 N 0.60 0.00 -0.20 0.00 1.08 -0.96 -3.18 115.11 112.46 1lud h GLN 33 Ca 0.59 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.65 1lud h GLN 33 Cb 1.15 0.00 -0.11 0.00 -0.05 0.00 0.00 27.48 28.47 1lud h GLN 33 CO -0.37 0.00 -0.56 0.25 -0.95 0.00 0.00 178.83 177.20 1lud n THR 34 N -2.82 2.30 -2.97 -0.54 -2.24 0.15 -4.96 114.28 103.20 1lud n THR 34 Ca 0.02 -3.47 -0.41 0.00 -2.27 0.00 0.00 64.05 57.92 1lud n THR 34 Cb 0.32 -0.46 -0.05 0.00 -2.10 0.00 0.00 70.33 68.04 1lud n THR 34 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1lud s VAL 35 N -3.57 4.93 -0.12 2.28 -7.23 -0.85 -3.64 120.40 112.20 1lud s VAL 35 Ca 0.41 1.49 0.00 0.00 -1.81 0.00 0.00 61.98 62.08 1lud s VAL 35 Cb 0.38 -4.07 0.00 0.00 0.56 0.00 0.00 36.38 33.25 1lud s VAL 35 CO -0.04 0.07 0.00 0.61 -0.31 0.00 0.00 175.10 175.43 1lud n GLY 36 N 3.52 0.48 3.49 2.32 0.00 -1.25 -5.01 105.19 108.74 1lud n GLY 36 Ca 0.02 -0.22 -0.24 0.00 0.00 0.00 0.00 46.02 45.59 1lud n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lud s LYS 37 N -0.92 1.70 -0.17 1.61 1.02 -1.24 -4.51 119.74 117.22 1lud s LYS 37 Ca 0.00 -1.88 -0.29 0.00 0.02 0.00 0.00 55.97 53.82 1lud s LYS 37 Cb 0.00 -1.42 -0.01 0.00 -0.52 0.00 0.00 37.83 35.89 1lud s LYS 37 CO 0.00 0.07 1.14 0.42 -0.92 0.00 0.00 175.35 176.06 1lud s ILE 38 N -2.83 4.49 -0.40 2.17 1.01 -1.03 -3.17 121.20 121.43 1lud s ILE 38 Ca 0.31 1.79 -0.13 0.00 0.00 0.00 0.00 60.65 62.62 1lud s ILE 38 Cb 0.04 -4.16 0.03 0.00 0.01 0.00 0.00 42.46 38.38 1lud s ILE 38 CO 0.14 -0.12 0.27 -0.32 0.00 0.00 0.00 174.94 174.91 1lud s MET 39 N 3.08 2.89 -0.32 2.79 1.75 0.61 0.61 119.30 130.72 1lud s MET 39 Ca 0.50 -1.11 -0.20 0.00 -1.25 0.00 0.00 55.69 53.63 1lud s MET 39 Cb -0.19 -3.89 -0.01 0.00 2.84 0.00 0.00 34.83 33.58 1lud s MET 39 CO 0.12 -0.78 0.61 0.08 -0.65 0.00 0.00 175.02 174.40 1lud s VAL 40 N 1.61 4.95 -0.05 10.11 1.01 0.79 0.34 120.40 139.15 1lud s VAL 40 Ca 0.04 0.73 0.02 0.00 0.00 0.00 0.00 61.98 62.76 1lud s VAL 40 Cb -0.20 -4.00 0.02 0.00 0.00 0.00 0.00 36.38 32.20 1lud s VAL 40 CO 0.08 -0.17 -0.09 0.68 0.00 0.00 0.00 175.10 175.60 1lud s VAL 41 N 2.58 0.84 0.72 2.92 -7.23 -0.58 -0.67 120.40 118.98 1lud s VAL 41 Ca 0.24 -0.31 -0.14 0.00 -1.81 0.00 0.00 61.98 59.95 1lud s VAL 41 Cb -0.15 -0.80 0.04 0.00 0.56 0.00 0.00 36.38 36.02 1lud s VAL 41 CO 0.12 0.29 1.14 -0.83 -0.31 0.00 0.00 175.10 175.52 1lud s GLY 42 N 0.73 2.11 0.61 2.32 0.00 -0.08 -1.27 107.32 111.75 1lud s GLY 42 Ca -0.13 0.63 0.26 0.00 0.00 0.00 0.00 44.72 45.48 1lud s GLY 42 CO 0.02 1.01 1.78 -0.09 0.00 0.00 0.00 173.10 175.81 1lud h ARG 43 N -0.42 0.00 0.00 2.90 1.12 -0.86 -0.42 114.38 116.71 1lud h ARG 43 Ca -0.46 0.00 -0.10 0.00 -1.11 0.00 0.00 59.98 58.31 1lud h ARG 43 Cb 1.26 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 31.23 1lud h ARG 43 CO 0.51 0.00 -0.40 0.00 -3.11 0.00 0.00 179.97 176.97 1lud h ARG 44 N 0.00 0.27 -0.06 0.20 2.47 -1.88 -2.64 114.38 112.73 1lud h ARG 44 Ca 0.00 -0.29 -0.03 0.00 -1.26 0.00 0.00 59.98 58.40 1lud h ARG 44 Cb 0.73 0.08 -0.00 0.00 -1.65 0.00 0.00 29.97 29.13 1lud h ARG 44 CO 0.00 1.00 -0.08 1.15 0.56 0.00 0.00 179.97 182.60 1lud h THR 45 N -0.35 1.39 -0.56 2.04 2.02 -1.45 -2.26 112.91 113.74 1lud h THR 45 Ca -0.05 -1.30 0.16 0.00 0.77 0.00 0.00 66.41 65.99 1lud h THR 45 Cb 1.14 2.12 -0.02 0.00 -1.74 0.00 0.00 68.15 69.66 1lud h THR 45 CO 0.08 0.36 0.40 0.22 0.37 0.00 0.00 175.52 176.95 1lud h TYR 46 N -0.31 0.01 0.00 3.16 3.20 -1.42 0.83 116.97 122.44 1lud h TYR 46 Ca 0.01 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1lud h TYR 46 Cb 0.62 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.88 1lud h TYR 46 CO 0.10 0.00 -0.22 0.93 -1.64 0.00 0.00 178.16 177.34 1lud h GLU 47 N 0.00 0.00 0.00 1.82 4.39 -1.27 -3.24 114.58 116.29 1lud h GLU 47 Ca 0.27 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.97 1lud h GLU 47 Cb 1.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 1lud h GLU 47 CO -0.00 0.00 -1.66 0.43 -1.16 0.00 0.00 179.01 176.61 1lud n SER 48 N -2.85 0.30 -4.41 1.42 7.64 0.17 -4.99 113.62 110.90 1lud n SER 48 Ca 0.03 -0.22 -0.42 0.00 1.01 0.00 0.00 58.87 59.27 1lud n SER 48 Cb 0.51 1.62 0.00 0.00 -1.01 0.00 0.00 64.21 65.34 1lud n SER 48 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1lud n PHE 49 N -2.09 -0.86 -0.03 1.43 3.01 0.24 -4.90 117.46 114.26 1lud n PHE 49 Ca -0.02 0.64 -0.01 0.00 1.01 0.00 0.00 57.45 59.08 1lud n PHE 49 Cb 0.51 -1.94 -0.00 0.00 -0.01 0.00 0.00 39.48 38.03 1lud n PHE 49 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1lud h PRO 50 N 0.73 0.00 -4.91 -1.08 0.13 -1.92 -3.45 132.00 121.50 1lud h PRO 50 Ca -0.38 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.08 1lud h PRO 50 Cb 1.41 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 32.25 1lud h PRO 50 CO 0.51 0.00 -0.71 0.15 -0.23 0.00 0.00 178.00 177.72 1lud s LYS 51 N -1.40 3.04 -0.05 0.86 -0.14 -1.26 -5.09 119.74 115.70 1lud s LYS 51 Ca -0.02 -0.86 -0.05 0.00 -1.36 0.00 0.00 55.97 53.68 1lud s LYS 51 Cb 0.00 -3.07 0.01 0.00 -1.68 0.00 0.00 37.83 33.09 1lud s LYS 51 CO 0.03 -0.35 0.15 -0.98 -0.76 0.00 0.00 175.35 173.43 1lud s ARG 52 N 1.40 0.21 0.79 1.68 1.70 -1.26 -4.41 118.95 119.06 1lud s ARG 52 Ca 0.02 0.14 -0.10 0.00 -0.47 0.00 0.00 55.73 55.32 1lud s ARG 52 Cb -0.16 0.10 0.09 0.00 -0.57 0.00 0.00 34.95 34.41 1lud s ARG 52 CO -0.03 -0.03 1.13 -1.25 -1.08 0.00 0.00 175.30 174.04 1lud s PRO 53 N -0.09 1.85 0.59 3.89 0.04 -1.26 -5.13 135.00 134.88 1lud s PRO 53 Ca -0.02 -0.15 -0.15 0.00 0.04 0.00 0.00 61.00 60.72 1lud s PRO 53 Cb -0.02 -2.03 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 1lud s PRO 53 CO 0.00 -1.58 1.03 -0.51 0.04 0.00 0.00 177.00 175.99 1lud s LEU 54 N -5.48 3.46 -0.16 -3.56 1.43 -1.26 -4.97 118.68 108.14 1lud s LEU 54 Ca 0.63 1.68 -0.29 0.00 -1.03 0.00 0.00 54.13 55.12 1lud s LEU 54 Cb -0.10 -4.51 -0.04 0.00 0.03 0.00 0.00 46.19 41.57 1lud s LEU 54 CO 0.48 -1.00 1.72 -2.16 0.23 0.00 0.00 176.35 175.62 1lud s PRO 55 N -4.30 3.83 -1.35 1.29 0.04 -1.26 -3.34 135.00 129.91 1lud s PRO 55 Ca 0.61 1.89 -0.00 0.00 0.04 0.00 0.00 61.00 63.54 1lud s PRO 55 Cb -0.13 -4.07 0.00 0.00 0.04 0.00 0.00 34.50 30.33 1lud s PRO 55 CO 0.39 -1.26 0.60 0.39 0.04 0.00 0.00 177.00 177.16 1lud n GLU 56 N 7.66 -4.31 -4.14 4.56 1.02 -1.26 -4.96 120.64 119.21 1lud n GLU 56 Ca 0.20 0.54 -0.17 0.00 -0.02 0.00 0.00 57.16 57.71 1lud n GLU 56 Cb 0.44 -4.94 -0.15 0.00 -0.02 0.00 0.00 31.44 26.77 1lud n GLU 56 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1lud s ARG 57 N -6.21 0.47 -0.31 3.49 3.00 -1.21 -3.88 118.95 114.30 1lud s ARG 57 Ca 0.02 -0.15 -0.28 0.00 0.00 0.00 0.00 55.73 55.32 1lud s ARG 57 Cb -0.01 -0.48 0.01 0.00 0.00 0.00 0.00 34.95 34.47 1lud s ARG 57 CO 0.84 0.07 1.01 0.99 0.00 0.00 0.00 175.30 178.21 1lud s THR 58 N 0.12 4.58 -0.09 0.02 2.01 -1.19 -4.70 115.64 116.39 1lud s THR 58 Ca -0.01 1.62 0.04 0.00 0.31 0.00 0.00 61.69 63.66 1lud s THR 58 Cb -0.05 -4.35 -0.00 0.00 0.01 0.00 0.00 72.50 68.11 1lud s THR 58 CO -0.00 -0.42 -0.23 0.20 -0.69 0.00 0.00 174.62 173.48 1lud s ASN 59 N 1.63 2.96 -0.06 3.53 0.02 -1.26 -0.28 114.94 121.47 1lud s ASN 59 Ca 0.42 -0.53 0.05 0.00 -1.02 0.00 0.00 52.86 51.78 1lud s ASN 59 Cb -0.13 -1.25 -0.00 0.00 0.02 0.00 0.00 41.25 39.89 1lud s ASN 59 CO 0.14 0.16 -0.21 -0.69 0.02 0.00 0.00 177.10 176.53 1lud s VAL 60 N 0.28 1.77 0.12 1.60 1.01 0.15 -1.35 120.40 123.98 1lud s VAL 60 Ca -0.16 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 60.96 1lud s VAL 60 Cb -0.17 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 1lud s VAL 60 CO 0.08 0.50 0.20 -0.69 0.00 0.00 0.00 175.10 175.18 1lud s VAL 61 N 0.10 5.00 -0.18 2.92 1.01 -1.11 -1.53 120.40 126.60 1lud s VAL 61 Ca -0.08 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.17 1lud s VAL 61 Cb -0.14 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.74 1lud s VAL 61 CO 0.04 -0.01 -0.17 -0.22 0.00 0.00 0.00 175.10 174.74 1lud s LEU 62 N -2.91 2.26 0.07 3.92 2.96 -0.40 -2.61 118.68 121.99 1lud s LEU 62 Ca 0.33 -0.60 -0.10 0.00 -0.22 0.00 0.00 54.13 53.54 1lud s LEU 62 Cb -0.11 -1.52 0.00 0.00 0.50 0.00 0.00 46.19 45.06 1lud s LEU 62 CO 0.26 0.01 0.22 0.28 -1.32 0.00 0.00 176.35 175.80 1lud s THR 63 N 1.25 0.12 -2.19 3.68 -1.32 -1.09 -0.08 115.64 116.01 1lud s THR 63 Ca 0.04 -1.00 0.21 0.00 -1.21 0.00 0.00 61.69 59.73 1lud s THR 63 Cb -0.14 -1.17 0.52 0.00 -1.51 0.00 0.00 72.50 70.21 1lud s THR 63 CO -0.10 -0.55 1.46 1.41 -2.21 0.00 0.00 174.62 174.63 1lud n HIS 64 N 0.20 0.70 -2.02 9.09 8.25 -1.26 -4.21 115.22 125.97 1lud n HIS 64 Ca -0.17 -0.35 -0.28 0.00 -0.26 0.00 0.00 57.72 56.66 1lud n HIS 64 Cb 0.61 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.83 1lud n HIS 64 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1lud s GLN 65 N -1.30 1.73 -0.01 -0.41 1.11 -1.26 -5.02 119.66 114.50 1lud s GLN 65 Ca 0.42 -0.15 0.05 0.00 0.01 0.00 0.00 55.36 55.68 1lud s GLN 65 Cb 0.23 -2.00 -0.07 0.00 -1.01 0.00 0.00 33.01 30.15 1lud s GLN 65 CO 0.30 -1.67 0.10 0.39 0.01 0.00 0.00 175.29 174.42 1lud n GLU 66 N -3.29 0.59 -1.05 2.91 1.02 -1.26 -4.63 120.64 114.93 1lud n GLU 66 Ca 0.10 -0.04 -0.14 0.00 -0.02 0.00 0.00 57.16 57.06 1lud n GLU 66 Cb 0.60 -1.12 0.17 0.00 -0.02 0.00 0.00 31.44 31.08 1lud n GLU 66 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1lud n ASP 67 N -1.74 3.40 -4.63 1.62 9.92 -1.26 -4.99 116.55 118.87 1lud n ASP 67 Ca -0.02 -3.75 -0.43 0.00 -0.53 0.00 0.00 54.79 50.07 1lud n ASP 67 Cb 0.20 -0.70 -0.03 0.00 -0.64 0.00 0.00 41.12 39.95 1lud n ASP 67 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 1lud s TYR 68 N -3.34 1.41 -0.47 1.24 5.04 -1.26 -4.93 117.35 115.04 1lud s TYR 68 Ca 0.50 0.22 -0.16 0.00 -2.44 0.00 0.00 57.07 55.19 1lud s TYR 68 Cb 0.44 -4.05 0.07 0.00 0.35 0.00 0.00 41.96 38.76 1lud s TYR 68 CO 0.03 -4.30 0.41 -0.65 -1.34 0.00 0.00 175.55 169.70 1lud s GLN 69 N 5.38 2.99 -0.44 4.97 -1.52 -1.26 -4.98 119.66 124.81 1lud s GLN 69 Ca 0.90 -1.29 0.03 0.00 -1.95 0.00 0.00 55.36 53.05 1lud s GLN 69 Cb -0.34 -4.12 0.16 0.00 -0.22 0.00 0.00 33.01 28.48 1lud s GLN 69 CO 0.36 -1.03 0.31 0.00 -0.25 0.00 0.00 175.29 174.68 1lud s ALA 70 N 1.74 1.68 0.06 6.09 0.00 -1.26 -5.10 121.76 124.97 1lud s ALA 70 Ca 0.05 -2.49 -0.30 0.00 0.00 0.00 0.00 51.96 49.22 1lud s ALA 70 Cb -0.23 -1.71 -0.06 0.00 0.00 0.00 0.00 23.12 21.12 1lud s ALA 70 CO 0.07 -2.03 1.17 -0.65 0.00 0.00 0.00 175.76 174.32 1lud s GLN 71 N 0.17 4.46 0.00 0.00 -0.21 -1.26 -3.06 119.66 119.76 1lud s GLN 71 Ca 0.26 1.73 0.00 0.00 0.02 0.00 0.00 55.36 57.37 1lud s GLN 71 Cb -0.08 -3.35 0.00 0.00 1.00 0.00 0.00 33.01 30.58 1lud s GLN 71 CO -0.11 -0.21 0.00 0.41 -2.12 0.00 0.00 175.29 173.26 1lud n GLY 72 N 3.09 2.82 3.58 3.09 0.00 -1.26 -5.03 105.19 111.47 1lud n GLY 72 Ca 0.08 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 45.19 1lud n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lud s ALA 73 N -1.43 2.97 0.93 4.61 0.00 -1.17 -4.88 121.76 122.79 1lud s ALA 73 Ca 0.00 -0.97 -0.10 0.00 0.00 0.00 0.00 51.96 50.89 1lud s ALA 73 Cb 0.00 -1.15 0.14 0.00 0.00 0.00 0.00 23.12 22.11 1lud s ALA 73 CO 0.00 0.59 1.07 0.28 0.00 0.00 0.00 175.76 177.70 1lud n VAL 74 N 1.88 0.00 -3.73 0.00 0.31 -0.46 -4.79 118.33 111.54 1lud n VAL 74 Ca -0.17 -0.03 -0.14 0.00 -0.01 0.00 0.00 64.34 63.99 1lud n VAL 74 Cb 0.53 -0.96 -0.15 0.00 -0.91 0.00 0.00 33.84 32.35 1lud n VAL 74 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1lud s VAL 75 N -2.61 -0.09 0.11 2.52 1.01 -1.26 -2.76 120.40 117.31 1lud s VAL 75 Ca 0.66 0.22 -0.07 0.00 0.00 0.00 0.00 61.98 62.79 1lud s VAL 75 Cb -0.23 -0.25 -0.01 0.00 0.00 0.00 0.00 36.38 35.89 1lud s VAL 75 CO 0.59 0.09 0.18 0.68 0.00 0.00 0.00 175.10 176.64 1lud s VAL 76 N 1.40 0.13 -0.10 2.92 -7.23 -1.07 -4.97 120.40 111.47 1lud s VAL 76 Ca -0.07 -1.38 0.23 0.00 -1.81 0.00 0.00 61.98 58.95 1lud s VAL 76 Cb -0.12 -1.57 0.45 0.00 0.56 0.00 0.00 36.38 35.71 1lud s VAL 76 CO -0.06 -0.57 1.16 1.41 -0.31 0.00 0.00 175.10 176.73 1lud n HIS 77 N -0.09 0.43 -3.19 2.82 8.25 -1.26 -2.68 115.22 119.50 1lud n HIS 77 Ca -0.12 -1.09 0.04 0.00 -0.26 0.00 0.00 57.72 56.30 1lud n HIS 77 Cb 0.63 -0.19 -0.02 0.00 1.12 0.00 0.00 29.99 31.53 1lud n HIS 77 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1lud s ASP 78 N -2.65 -0.76 0.52 0.41 1.01 -1.26 -4.91 116.67 109.03 1lud s ASP 78 Ca 0.34 0.55 0.40 0.00 0.71 0.00 0.00 52.55 54.55 1lud s ASP 78 Cb 0.37 1.67 1.59 0.00 1.01 0.00 0.00 42.92 47.56 1lud s ASP 78 CO -0.12 -0.14 1.67 0.58 0.21 0.00 0.00 175.17 177.36 1lud h VAL 79 N 5.56 0.18 -0.92 -1.27 2.07 -1.98 0.74 116.25 120.64 1lud h VAL 79 Ca -0.17 -0.01 0.03 0.00 0.82 0.00 0.00 66.70 67.37 1lud h VAL 79 Cb 1.16 0.14 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 1lud h VAL 79 CO 0.04 0.01 0.60 0.00 0.02 0.00 0.00 177.57 178.23 1lud h ALA 80 N 1.29 1.20 -0.27 1.67 0.00 -1.99 -0.69 119.26 120.47 1lud h ALA 80 Ca 0.78 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.60 1lud h ALA 80 Cb 2.95 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 20.40 1lud h ALA 80 CO -0.11 0.48 -0.03 0.00 0.00 0.00 0.00 179.25 179.59 1lud h ALA 81 N 1.37 0.36 -0.88 0.00 0.00 0.10 -2.71 119.26 117.50 1lud h ALA 81 Ca 0.36 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1lud h ALA 81 Cb -0.03 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 1lud h ALA 81 CO -0.11 0.13 0.54 0.28 0.00 0.00 0.00 179.25 180.09 1lud h VAL 82 N 0.26 1.24 0.00 0.00 2.07 -1.32 -0.84 116.25 117.65 1lud h VAL 82 Ca 0.07 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 1lud h VAL 82 Cb 0.47 -0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1lud h VAL 82 CO 0.02 0.24 -0.09 -0.26 0.02 0.00 0.00 177.57 177.50 1lud h PHE 83 N 1.20 0.00 0.00 1.57 0.04 -1.01 -1.71 116.94 117.03 1lud h PHE 83 Ca 0.32 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.98 1lud h PHE 83 Cb -0.07 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.06 1lud h PHE 83 CO -0.00 0.09 -0.53 0.00 -0.60 0.00 0.00 178.31 177.27 1lud h ALA 84 N 1.91 0.75 0.06 2.45 0.00 -0.84 -3.05 119.26 120.54 1lud h ALA 84 Ca -0.00 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 1lud h ALA 84 Cb 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1lud h ALA 84 CO 0.01 0.66 -0.03 -0.92 0.00 0.00 0.00 179.25 178.97 1lud h TYR 85 N 0.00 -0.07 -0.85 0.00 3.20 -0.98 -2.64 116.97 115.62 1lud h TYR 85 Ca -0.01 -0.00 0.12 0.00 3.14 0.00 0.00 58.73 61.99 1lud h TYR 85 Cb 1.26 0.02 -0.08 0.00 1.54 0.00 0.00 36.73 39.47 1lud h TYR 85 CO 0.00 0.54 0.47 0.00 -1.64 0.00 0.00 178.16 177.53 1lud h ALA 86 N -0.00 1.26 0.00 1.82 0.00 -1.62 0.63 119.26 121.34 1lud h ALA 86 Ca -0.01 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1lud h ALA 86 Cb 0.64 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1lud h ALA 86 CO 0.01 0.02 -0.12 0.87 0.00 0.00 0.00 179.25 180.03 1lud h LYS 87 N 0.73 0.00 0.06 0.00 1.79 -1.57 -2.61 116.57 114.97 1lud h LYS 87 Ca 0.44 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 58.62 1lud h LYS 87 Cb 0.52 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.14 1lud h LYS 87 CO -0.30 0.12 -1.57 1.96 -1.08 0.00 0.00 179.45 178.58 1lud h GLN 88 N 0.00 0.12 -5.68 3.15 7.50 0.44 -3.45 115.11 117.19 1lud h GLN 88 Ca -0.00 -0.21 -0.59 0.00 0.50 0.00 0.00 58.65 58.35 1lud h GLN 88 Cb 0.27 0.08 -0.09 0.00 0.05 0.00 0.00 27.48 27.78 1lud h GLN 88 CO 0.02 0.88 0.10 -1.01 -1.50 0.00 0.00 178.83 177.32 1lud s HIS 89 N -2.62 3.39 -0.07 2.96 3.76 0.90 -4.97 115.29 118.64 1lud s HIS 89 Ca -0.07 0.94 -0.21 0.00 -0.15 0.00 0.00 55.06 55.57 1lud s HIS 89 Cb 0.08 -2.78 -0.16 0.00 1.11 0.00 0.00 32.58 30.82 1lud s HIS 89 CO 0.83 -0.14 0.81 -1.00 -0.85 0.00 0.00 174.74 174.38 1lud h PRO 90 N 7.40 -0.15 -0.67 8.40 0.13 -1.87 -3.30 132.00 141.94 1lud h PRO 90 Ca -0.32 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1lud h PRO 90 Cb 1.15 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1lud h PRO 90 CO 0.77 0.34 0.00 -0.25 -0.23 0.00 0.00 178.00 178.63 1lud n ASP 91 N -4.86 4.68 -3.51 1.44 9.92 -1.26 -4.69 116.55 118.26 1lud n ASP 91 Ca -0.07 -2.70 -0.27 0.00 -0.53 0.00 0.00 54.79 51.21 1lud n ASP 91 Cb 0.27 -0.64 -0.14 0.00 -0.64 0.00 0.00 41.12 39.98 1lud n ASP 91 CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 1lud s GLN 92 N -2.34 0.24 0.00 -1.24 0.74 -1.24 -4.76 119.66 111.05 1lud s GLN 92 Ca 0.43 -0.54 0.00 0.00 0.05 0.00 0.00 55.36 55.30 1lud s GLN 92 Cb 0.32 -1.09 0.00 0.00 1.10 0.00 0.00 33.01 33.34 1lud s GLN 92 CO 0.13 -1.04 0.00 0.39 -0.55 0.00 0.00 175.29 174.22 1lud n GLU 93 N 5.15 2.32 -3.86 1.67 4.71 -1.26 -4.40 120.64 124.98 1lud n GLU 93 Ca -0.04 0.00 -0.36 0.00 -0.01 0.00 0.00 57.16 56.76 1lud n GLU 93 Cb 0.42 0.00 -0.13 0.00 -1.01 0.00 0.00 31.44 30.72 1lud n GLU 93 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 1lud s LEU 94 N 0.00 3.17 -0.13 -4.62 2.96 -1.26 -2.47 118.68 116.33 1lud s LEU 94 Ca 0.00 -0.29 0.02 0.00 -0.22 0.00 0.00 54.13 53.64 1lud s LEU 94 Cb 0.00 -1.83 0.00 0.00 0.50 0.00 0.00 46.19 44.86 1lud s LEU 94 CO 0.00 -0.02 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.12 1lud s VAL 95 N 1.49 2.23 0.24 1.68 1.01 0.20 -1.12 120.40 126.14 1lud s VAL 95 Ca 0.06 -0.93 -0.19 0.00 0.00 0.00 0.00 61.98 60.92 1lud s VAL 95 Cb -0.15 -1.90 -0.08 0.00 0.00 0.00 0.00 36.38 34.25 1lud s VAL 95 CO 0.00 0.54 0.72 -0.63 0.00 0.00 0.00 175.10 175.74 1lud s ILE 96 N 0.68 4.60 0.00 2.22 -1.09 0.44 -0.15 121.20 127.89 1lud s ILE 96 Ca -0.10 1.21 0.00 0.00 -2.23 0.00 0.00 60.65 59.53 1lud s ILE 96 Cb -0.16 -3.81 0.00 0.00 -1.58 0.00 0.00 42.46 36.91 1lud s ILE 96 CO 0.01 0.14 0.21 0.00 -1.23 0.00 0.00 174.94 174.07 1lud n ALA 97 N 0.53 1.39 0.00 9.38 0.00 0.16 -2.11 120.51 129.85 1lud n ALA 97 Ca -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1lud n ALA 97 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 1lud n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lud n GLY 98 N 0.16 -1.22 0.00 0.00 0.00 -1.16 -4.91 105.19 98.07 1lud n GLY 98 Ca 0.00 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.23 1lud n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lud n GLY 99 N 0.00 -1.05 0.29 -0.02 0.00 -1.26 -0.90 105.19 102.24 1lud n GLY 99 Ca 0.00 -1.08 -0.06 0.00 0.00 0.00 0.00 46.02 44.88 1lud n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lud h ALA 100 N -2.00 0.89 -0.90 4.61 0.00 -1.92 -2.43 119.26 117.51 1lud h ALA 100 Ca 0.00 -0.11 0.10 0.00 0.00 0.00 0.00 54.91 54.90 1lud h ALA 100 Cb 0.00 -0.28 -0.07 0.00 0.00 0.00 0.00 17.79 17.45 1lud h ALA 100 CO 0.00 0.40 0.58 1.96 0.00 0.00 0.00 179.25 182.19 1lud h GLN 101 N 0.95 0.85 0.00 0.00 1.08 -1.95 -1.00 115.11 115.03 1lud h GLN 101 Ca 0.24 -0.05 -0.09 0.00 -1.45 0.00 0.00 58.65 57.30 1lud h GLN 101 Cb 0.04 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.26 1lud h GLN 101 CO -0.04 0.56 -0.45 0.82 -0.95 0.00 0.00 178.83 178.78 1lud h ILE 102 N 0.87 0.82 0.00 2.54 1.08 -1.67 -3.07 117.51 118.09 1lud h ILE 102 Ca 0.42 -1.97 -0.03 0.00 -0.39 0.00 0.00 64.86 62.89 1lud h ILE 102 Cb 0.44 2.27 -0.00 0.00 -3.07 0.00 0.00 36.82 36.45 1lud h ILE 102 CO -0.19 0.44 -0.13 -0.26 -0.69 0.00 0.00 178.15 177.32 1lud h PHE 103 N 0.00 0.00 0.00 1.37 0.04 -0.80 -2.93 116.94 114.62 1lud h PHE 103 Ca -0.00 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.75 1lud h PHE 103 Cb 1.23 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.38 1lud h PHE 103 CO 0.00 0.13 -0.08 1.15 -0.60 0.00 0.00 178.31 178.91 1lud h THR 104 N 0.00 1.21 0.00 -1.55 2.02 -1.35 -1.25 112.91 111.99 1lud h THR 104 Ca -0.00 -1.94 -0.01 0.00 0.77 0.00 0.00 66.41 65.24 1lud h THR 104 Cb 0.84 2.31 -0.00 0.00 -1.74 0.00 0.00 68.15 69.56 1lud h THR 104 CO 0.02 0.41 -0.03 0.00 0.37 0.00 0.00 175.52 176.28 1lud h ALA 105 N -0.33 1.66 -0.02 6.16 0.00 -1.62 -2.00 119.26 123.11 1lud h ALA 105 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1lud h ALA 105 Cb 0.73 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1lud h ALA 105 CO -0.01 0.04 -0.46 1.19 0.00 0.00 0.00 179.25 180.01 1lud n PHE 106 N -4.09 0.00 -0.22 0.00 3.01 -1.11 -4.45 117.46 110.61 1lud n PHE 106 Ca -0.03 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.49 1lud n PHE 106 Cb 0.12 0.00 0.32 0.00 -0.01 0.00 0.00 39.48 39.91 1lud n PHE 106 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 1lud h LYS 107 N 2.44 0.81 -0.45 -1.08 2.10 -0.43 -1.99 116.57 117.99 1lud h LYS 107 Ca 0.00 -0.05 -0.08 0.00 -2.00 0.00 0.00 60.65 58.52 1lud h LYS 107 Cb 0.75 -0.18 -0.02 0.00 -0.90 0.00 0.00 32.23 31.88 1lud h LYS 107 CO 0.00 0.54 -0.06 0.22 -2.00 0.00 0.00 179.45 178.15 1lud h ASP 108 N 0.84 0.75 -3.86 7.07 3.58 -1.78 -3.35 116.42 119.66 1lud h ASP 108 Ca 0.33 -0.20 -0.72 0.00 0.42 0.00 0.00 57.03 56.86 1lud h ASP 108 Cb 0.23 -0.20 -0.33 0.00 1.72 0.00 0.00 39.33 40.75 1lud h ASP 108 CO -0.11 0.85 -0.16 -1.81 -2.88 0.00 0.00 179.24 175.12 1lud s ASP 109 N -6.68 5.83 -0.04 2.28 1.11 -0.75 -5.05 116.67 113.38 1lud s ASP 109 Ca -0.09 -3.10 0.06 0.00 0.18 0.00 0.00 52.55 49.60 1lud s ASP 109 Cb 0.14 -1.95 -0.01 0.00 1.07 0.00 0.00 42.92 42.17 1lud s ASP 109 CO 0.81 -0.35 -0.23 -0.69 1.18 0.00 0.00 175.17 175.89 1lud s VAL 110 N -0.44 1.87 -0.08 -1.27 1.01 -1.25 -4.83 120.40 115.42 1lud s VAL 110 Ca 0.21 -0.99 0.04 0.00 0.00 0.00 0.00 61.98 61.24 1lud s VAL 110 Cb -0.14 -1.57 -0.08 0.00 0.00 0.00 0.00 36.38 34.59 1lud s VAL 110 CO -0.07 0.53 -0.01 0.47 0.00 0.00 0.00 175.10 176.01 1lud n ASP 111 N 2.75 3.30 -3.74 3.32 8.00 0.37 -4.70 116.55 125.85 1lud n ASP 111 Ca -0.17 -0.02 -0.12 0.00 0.71 0.00 0.00 54.79 55.19 1lud n ASP 111 Cb 0.52 0.39 -0.12 0.00 -0.02 0.00 0.00 41.12 41.88 1lud n ASP 111 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1lud s THR 112 N -2.17 -0.03 -0.15 -3.53 2.01 -0.94 -2.36 115.64 108.47 1lud s THR 112 Ca -0.06 0.09 -0.03 0.00 0.31 0.00 0.00 61.69 62.00 1lud s THR 112 Cb 0.02 -0.40 -0.02 0.00 0.01 0.00 0.00 72.50 72.11 1lud s THR 112 CO 0.26 0.04 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.40 1lud s LEU 113 N 0.90 3.13 -0.31 4.42 1.43 -0.44 0.62 118.68 128.43 1lud s LEU 113 Ca -0.06 -0.17 0.02 0.00 -1.03 0.00 0.00 54.13 52.89 1lud s LEU 113 Cb -0.07 -1.74 0.09 0.00 0.03 0.00 0.00 46.19 44.50 1lud s LEU 113 CO -0.06 0.18 0.05 -0.76 0.23 0.00 0.00 176.35 175.99 1lud s LEU 114 N 0.30 3.44 0.02 1.79 1.43 0.30 0.62 118.68 126.59 1lud s LEU 114 Ca -0.05 -1.80 0.08 0.00 -1.03 0.00 0.00 54.13 51.34 1lud s LEU 114 Cb -0.14 -1.26 -0.03 0.00 0.03 0.00 0.00 46.19 44.78 1lud s LEU 114 CO 0.04 -0.37 -0.25 0.54 0.23 0.00 0.00 176.35 176.54 1lud s VAL 115 N 1.25 2.22 -0.26 -1.59 0.11 -0.90 -1.96 120.40 119.28 1lud s VAL 115 Ca 0.08 -1.25 -0.06 0.00 -2.93 0.00 0.00 61.98 57.81 1lud s VAL 115 Cb -0.18 -1.84 -0.01 0.00 -1.53 0.00 0.00 36.38 32.81 1lud s VAL 115 CO -0.14 0.44 0.04 -0.89 -3.33 0.00 0.00 175.10 171.22 1lud s THR 116 N -0.75 3.92 -0.38 5.04 2.01 -1.07 0.07 115.64 124.46 1lud s THR 116 Ca 0.11 -0.44 -0.17 0.00 0.31 0.00 0.00 61.69 61.50 1lud s THR 116 Cb -0.10 -2.88 0.01 0.00 0.01 0.00 0.00 72.50 69.53 1lud s THR 116 CO 0.01 0.28 0.46 -0.13 -0.69 0.00 0.00 174.62 174.55 1lud s ARG 117 N 1.54 3.38 0.48 4.92 0.52 -0.63 -0.27 118.95 128.88 1lud s ARG 117 Ca 0.05 -0.47 -0.13 0.00 -0.52 0.00 0.00 55.73 54.66 1lud s ARG 117 Cb -0.16 -3.88 -0.07 0.00 0.52 0.00 0.00 34.95 31.37 1lud s ARG 117 CO 0.01 -0.73 0.90 -0.51 0.02 0.00 0.00 175.30 174.99 1lud s LEU 118 N 2.25 3.67 0.07 2.53 1.02 -0.41 -1.63 118.68 126.18 1lud s LEU 118 Ca 0.15 1.36 0.08 0.00 0.02 0.00 0.00 54.13 55.74 1lud s LEU 118 Cb -0.16 -4.29 -0.22 0.00 0.02 0.00 0.00 46.19 41.54 1lud s LEU 118 CO 0.14 -0.54 1.10 0.00 0.02 0.00 0.00 176.35 177.07 1lud h ALA 119 N 0.92 0.47 -2.54 4.21 0.00 -0.80 -3.21 119.26 118.31 1lud h ALA 119 Ca -0.47 -1.07 -0.47 0.00 0.00 0.00 0.00 54.91 52.91 1lud h ALA 119 Cb 1.19 0.03 0.12 0.00 0.00 0.00 0.00 17.79 19.12 1lud h ALA 119 CO 0.62 1.34 0.35 0.20 0.00 0.00 0.00 179.25 181.76 1lud s GLY 120 N -4.82 1.58 -0.19 0.00 0.00 -1.18 -4.78 107.32 97.93 1lud s GLY 120 Ca -0.01 -0.55 0.01 0.00 0.00 0.00 0.00 44.72 44.17 1lud s GLY 120 CO 0.82 -0.03 -0.13 -1.35 0.00 0.00 0.00 173.10 172.42 1lud s SER 121 N -4.24 3.28 0.29 1.64 1.04 -1.26 -3.45 113.70 111.00 1lud s SER 121 Ca 0.63 -0.80 0.08 0.00 0.48 0.00 0.00 55.95 56.34 1lud s SER 121 Cb -0.13 -1.28 -0.04 0.00 0.10 0.00 0.00 66.02 64.67 1lud s SER 121 CO 0.52 -0.11 0.11 -0.36 0.98 0.00 0.00 173.24 174.38 1lud s PHE 122 N 1.38 2.80 0.29 5.02 0.40 -1.26 -5.05 117.98 121.55 1lud s PHE 122 Ca 0.00 -0.26 0.11 0.00 -0.60 0.00 0.00 56.93 56.19 1lud s PHE 122 Cb -0.15 -1.44 -0.05 0.00 0.51 0.00 0.00 43.02 41.89 1lud s PHE 122 CO -0.09 0.47 -0.16 -1.83 0.70 0.00 0.00 175.22 174.30 1lud s GLU 123 N -3.79 1.77 0.00 0.44 -1.05 -1.26 -4.84 118.70 109.97 1lud s GLU 123 Ca 0.35 -1.75 0.00 0.00 -0.15 0.00 0.00 54.97 53.41 1lud s GLU 123 Cb -0.05 -1.81 0.00 0.00 -0.44 0.00 0.00 34.13 31.83 1lud s GLU 123 CO 0.22 0.31 0.00 0.41 0.95 0.00 0.00 175.26 177.15 1lud n GLY 124 N -0.68 1.48 0.00 -3.83 0.00 -1.26 -4.94 105.19 95.96 1lud n GLY 124 Ca -0.05 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1lud n GLY 124 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1lud n ASP 125 N 0.00 0.26 -4.28 1.61 9.92 -1.26 -5.02 116.55 117.78 1lud n ASP 125 Ca 0.00 -0.15 -0.35 0.00 -0.53 0.00 0.00 54.79 53.76 1lud n ASP 125 Cb 0.00 0.35 -0.14 0.00 -0.64 0.00 0.00 41.12 40.69 1lud n ASP 125 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1lud s THR 126 N -0.40 3.18 0.25 -3.53 2.01 -1.26 -5.10 115.64 110.79 1lud s THR 126 Ca 0.00 -0.56 0.06 0.00 0.31 0.00 0.00 61.69 61.50 1lud s THR 126 Cb 0.00 -2.43 -0.05 0.00 0.01 0.00 0.00 72.50 70.02 1lud s THR 126 CO 0.00 0.44 -0.07 -0.54 -0.69 0.00 0.00 174.62 173.76 1lud s LYS 127 N 1.43 1.45 0.75 4.92 1.02 -1.26 -2.96 119.74 125.09 1lud s LYS 127 Ca 0.05 -1.71 -0.14 0.00 0.02 0.00 0.00 55.97 54.19 1lud s LYS 127 Cb -0.14 -1.03 0.05 0.00 -0.52 0.00 0.00 37.83 36.19 1lud s LYS 127 CO -0.04 0.05 1.18 1.41 -0.92 0.00 0.00 175.35 177.02 1lud s MET 128 N -3.73 2.05 0.88 1.68 1.75 -1.20 -4.84 119.30 115.89 1lud s MET 128 Ca 0.27 1.66 -0.12 0.00 -1.25 0.00 0.00 55.69 56.25 1lud s MET 128 Cb 0.03 -1.83 0.12 0.00 2.84 0.00 0.00 34.83 35.99 1lud s MET 128 CO 0.10 -1.88 1.13 0.96 -0.65 0.00 0.00 175.02 174.67 1lud s ILE 129 N -2.17 2.30 -0.63 10.11 -4.36 -1.26 -4.95 121.20 120.25 1lud s ILE 129 Ca 0.72 0.10 -0.27 0.00 -0.26 0.00 0.00 60.65 60.94 1lud s ILE 129 Cb -0.27 -2.84 -0.00 0.00 1.25 0.00 0.00 42.46 40.60 1lud s ILE 129 CO 0.47 -0.13 1.62 -2.16 0.24 0.00 0.00 174.94 174.98 1lud s PRO 130 N -5.24 2.92 0.36 0.37 0.05 -1.26 -5.01 135.00 127.19 1lud s PRO 130 Ca 0.63 0.36 -0.03 0.00 0.05 0.00 0.00 61.00 62.01 1lud s PRO 130 Cb -0.15 -4.28 -0.04 0.00 0.05 0.00 0.00 34.50 30.08 1lud s PRO 130 CO 0.54 -2.41 0.61 -0.51 0.05 0.00 0.00 177.00 175.27 1lud s LEU 131 N 7.55 3.93 -1.17 -3.56 1.43 -1.26 -5.01 118.68 120.60 1lud s LEU 131 Ca 0.56 0.66 -0.07 0.00 -1.03 0.00 0.00 54.13 54.25 1lud s LEU 131 Cb -0.11 -3.53 0.25 0.00 0.03 0.00 0.00 46.19 42.83 1lud s LEU 131 CO 0.20 -0.33 1.64 -3.20 0.23 0.00 0.00 176.35 174.89 1lud n ASN 132 N -1.62 5.81 -0.15 2.29 5.15 -1.26 -4.80 115.26 120.68 1lud n ASN 132 Ca -0.02 -3.27 0.26 0.00 -0.60 0.00 0.00 54.58 50.95 1lud n ASN 132 Cb 0.55 -1.37 0.70 0.00 -0.53 0.00 0.00 39.78 39.14 1lud n ASN 132 CO 0.00 0.00 0.00 -0.50 1.40 0.00 0.00 177.26 178.16 1lud h TRP 133 N 5.64 0.03 0.00 1.20 4.06 -1.95 0.43 115.95 125.37 1lud h TRP 133 Ca 0.28 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.21 1lud h TRP 133 Cb 0.63 -0.01 -0.00 0.00 -1.00 0.00 0.00 29.16 28.78 1lud h TRP 133 CO 1.11 0.01 -0.13 0.22 -3.56 0.00 0.00 178.44 176.09 1lud h ASP 134 N 0.03 0.00 0.63 -3.49 3.58 -2.04 -1.37 116.42 113.75 1lud h ASP 134 Ca 0.39 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.84 1lud h ASP 134 Cb 1.54 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.59 1lud h ASP 134 CO -0.02 0.13 -0.50 -0.67 -2.88 0.00 0.00 179.24 175.31 1lud n ASP 135 N -3.75 0.51 -4.62 2.28 -0.08 0.15 -4.89 116.55 106.14 1lud n ASP 135 Ca -0.02 -0.09 -0.25 0.00 -1.51 0.00 0.00 54.79 52.91 1lud n ASP 135 Cb 0.24 0.17 -0.09 0.00 2.34 0.00 0.00 41.12 43.78 1lud n ASP 135 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 1lud s PHE 136 N -3.05 2.52 -0.02 -0.67 0.40 -0.52 -3.70 117.98 112.94 1lud s PHE 136 Ca 0.10 -0.50 0.01 0.00 -0.60 0.00 0.00 56.93 55.94 1lud s PHE 136 Cb 0.17 -1.56 0.01 0.00 0.51 0.00 0.00 43.02 42.15 1lud s PHE 136 CO 0.69 0.47 -0.04 0.99 0.70 0.00 0.00 175.22 178.03 1lud s THR 137 N -2.58 0.43 -0.17 0.64 2.01 -1.08 -4.87 115.64 110.02 1lud s THR 137 Ca 0.35 -0.14 -0.29 0.00 0.31 0.00 0.00 61.69 61.92 1lud s THR 137 Cb 0.02 -0.43 -0.02 0.00 0.01 0.00 0.00 72.50 72.08 1lud s THR 137 CO 0.19 0.17 1.41 -0.75 -0.69 0.00 0.00 174.62 174.94 1lud s LYS 138 N 0.46 4.11 -0.06 4.92 2.20 -1.26 -1.62 119.74 128.49 1lud s LYS 138 Ca -0.05 1.71 0.21 0.00 -0.36 0.00 0.00 55.97 57.48 1lud s LYS 138 Cb -0.09 -3.87 -0.30 0.00 -1.51 0.00 0.00 37.83 32.06 1lud s LYS 138 CO -0.00 -0.89 0.41 1.33 -0.36 0.00 0.00 175.35 175.84 1lud n VAL 139 N 5.68 0.39 -3.80 4.02 0.24 0.11 -4.94 118.33 120.03 1lud n VAL 139 Ca 0.15 -0.59 -0.13 0.00 -2.04 0.00 0.00 64.34 61.73 1lud n VAL 139 Cb 0.45 -0.14 -0.13 0.00 -1.47 0.00 0.00 33.84 32.54 1lud n VAL 139 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1lud s SER 140 N -4.81 -0.14 -0.13 -1.34 0.01 -1.16 -5.03 113.70 101.09 1lud s SER 140 Ca -0.08 0.30 -0.08 0.00 1.31 0.00 0.00 55.95 57.39 1lud s SER 140 Cb 0.12 0.26 0.04 0.00 0.21 0.00 0.00 66.02 66.66 1lud s SER 140 CO 0.88 -0.08 0.32 -0.94 0.41 0.00 0.00 173.24 173.84 1lud s SER 141 N 0.41 -0.37 -0.05 2.44 1.04 -1.26 -0.89 113.70 115.02 1lud s SER 141 Ca -0.03 0.68 0.02 0.00 0.48 0.00 0.00 55.95 57.11 1lud s SER 141 Cb -0.04 0.60 0.01 0.00 0.10 0.00 0.00 66.02 66.69 1lud s SER 141 CO -0.02 -0.16 -0.11 -0.60 0.98 0.00 0.00 173.24 173.34 1lud s ARG 142 N 0.93 1.47 -0.24 4.02 3.52 -0.70 -4.95 118.95 122.99 1lud s ARG 142 Ca -0.06 -0.37 -0.09 0.00 -0.13 0.00 0.00 55.73 55.07 1lud s ARG 142 Cb -0.07 -1.26 -0.04 0.00 -1.56 0.00 0.00 34.95 32.02 1lud s ARG 142 CO -0.07 0.05 0.12 0.99 -0.81 0.00 0.00 175.30 175.58 1lud s THR 143 N 0.55 4.93 -0.16 4.11 2.01 -1.26 -0.31 115.64 125.50 1lud s THR 143 Ca -0.11 0.03 0.01 0.00 0.31 0.00 0.00 61.69 61.93 1lud s THR 143 Cb -0.14 -3.30 0.01 0.00 0.01 0.00 0.00 72.50 69.08 1lud s THR 143 CO 0.03 0.35 -0.19 0.54 -0.69 0.00 0.00 174.62 174.65 1lud s VAL 144 N 1.20 2.21 0.47 3.82 0.11 -0.90 -5.02 120.40 122.29 1lud s VAL 144 Ca 0.06 -0.91 -0.04 0.00 -2.93 0.00 0.00 61.98 58.16 1lud s VAL 144 Cb -0.14 -1.92 -0.03 0.00 -1.53 0.00 0.00 36.38 32.76 1lud s VAL 144 CO 0.05 0.53 0.75 -1.61 -3.33 0.00 0.00 175.10 171.49 1lud s GLU 145 N 1.05 3.45 0.05 1.54 2.02 -1.26 -2.89 118.70 122.66 1lud s GLU 145 Ca -0.01 0.05 -0.01 0.00 0.02 0.00 0.00 54.97 55.01 1lud s GLU 145 Cb -0.14 -2.43 -0.03 0.00 0.10 0.00 0.00 34.13 31.63 1lud s GLU 145 CO -0.06 -0.19 -0.01 0.34 0.02 0.00 0.00 175.26 175.35 1lud s ASP 146 N -4.12 0.43 0.33 -0.19 -1.08 -1.26 -4.95 116.67 105.83 1lud s ASP 146 Ca 0.47 -0.90 0.24 0.00 -0.52 0.00 0.00 52.55 51.84 1lud s ASP 146 Cb -0.10 0.19 1.21 0.00 -1.46 0.00 0.00 42.92 42.76 1lud s ASP 146 CO 0.43 -0.56 1.72 0.71 0.52 0.00 0.00 175.17 177.99 1lud h THR 147 N 3.35 0.00 -3.54 1.71 1.35 -1.99 -3.40 112.91 110.39 1lud h THR 147 Ca -0.34 -0.06 -0.64 0.00 -0.55 0.00 0.00 66.41 64.82 1lud h THR 147 Cb 1.15 0.64 -0.21 0.00 -1.73 0.00 0.00 68.15 68.01 1lud h THR 147 CO 0.62 0.00 -0.61 0.21 -0.25 0.00 0.00 175.52 175.49 1lud s ASN 148 N -4.19 5.27 0.22 5.36 3.84 -1.26 -5.00 114.94 119.19 1lud s ASN 148 Ca -0.01 -0.12 -0.12 0.00 0.21 0.00 0.00 52.86 52.83 1lud s ASN 148 Cb 0.07 -1.93 0.29 0.00 -0.55 0.00 0.00 41.25 39.13 1lud s ASN 148 CO 0.26 0.04 1.64 -0.65 -2.79 0.00 0.00 177.10 175.60 1lud h PRO 149 N 7.72 0.06 0.02 0.43 0.10 -1.99 -1.38 132.00 136.96 1lud h PRO 149 Ca -0.37 -0.00 -0.20 0.00 0.10 0.00 0.00 66.00 65.52 1lud h PRO 149 Cb 1.18 -0.01 -0.02 0.00 0.10 0.00 0.00 31.00 32.24 1lud h PRO 149 CO 0.61 0.04 -0.95 0.00 0.10 0.00 0.00 178.00 177.79 1lud h ALA 150 N 1.61 0.44 0.00 -0.75 0.00 -1.94 -3.12 119.26 115.49 1lud h ALA 150 Ca 0.33 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1lud h ALA 150 Cb 0.52 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1lud h ALA 150 CO -0.60 1.09 0.00 1.28 0.00 0.00 0.00 179.25 181.01 1lud n LEU 151 N -3.49 0.00 -4.77 0.00 4.77 -0.56 -3.08 117.00 109.86 1lud n LEU 151 Ca -0.02 0.13 -0.37 0.00 -0.03 0.00 0.00 56.01 55.72 1lud n LEU 151 Cb 0.88 -0.13 -0.01 0.00 -2.33 0.00 0.00 43.42 41.82 1lud n LEU 151 CO 0.47 -0.06 0.83 -0.89 -1.33 0.00 0.00 177.39 176.42 1lud s THR 152 N -2.26 3.15 0.15 -5.08 2.01 -0.95 -4.69 115.64 107.97 1lud s THR 152 Ca 0.23 0.90 -0.25 0.00 0.31 0.00 0.00 61.69 62.88 1lud s THR 152 Cb 0.12 -3.47 0.06 0.00 0.01 0.00 0.00 72.50 69.22 1lud s THR 152 CO 0.24 0.02 0.92 -1.38 -0.69 0.00 0.00 174.62 173.73 1lud s HIS 153 N -1.51 -0.16 0.09 4.92 -3.43 -1.14 -0.38 115.29 113.68 1lud s HIS 153 Ca 0.61 -0.14 0.07 0.00 -0.80 0.00 0.00 55.06 54.79 1lud s HIS 153 Cb -0.29 0.64 -0.03 0.00 -1.43 0.00 0.00 32.58 31.47 1lud s HIS 153 CO 0.36 -0.85 -0.17 0.99 -2.00 0.00 0.00 174.74 173.07 1lud s THR 154 N -3.35 1.39 -0.25 -5.38 2.01 -0.65 -2.12 115.64 107.29 1lud s THR 154 Ca 0.11 -1.44 -0.09 0.00 0.31 0.00 0.00 61.69 60.59 1lud s THR 154 Cb -0.02 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 71.14 1lud s THR 154 CO 0.02 -0.17 0.11 -0.31 -0.69 0.00 0.00 174.62 173.57 1lud s TYR 155 N -1.30 3.16 0.12 4.92 2.02 0.57 -1.61 117.35 125.25 1lud s TYR 155 Ca 0.02 -0.14 0.04 0.00 -0.37 0.00 0.00 57.07 56.63 1lud s TYR 155 Cb -0.10 -2.25 -0.04 0.00 -0.40 0.00 0.00 41.96 39.17 1lud s TYR 155 CO 0.03 -0.19 0.09 -1.21 -1.57 0.00 0.00 175.55 172.71 1lud s GLU 156 N 1.41 2.83 -0.09 -0.62 2.02 0.11 -1.72 118.70 122.64 1lud s GLU 156 Ca 0.06 -0.81 -0.03 0.00 0.02 0.00 0.00 54.97 54.21 1lud s GLU 156 Cb -0.15 -2.65 0.05 0.00 0.10 0.00 0.00 34.13 31.48 1lud s GLU 156 CO 0.05 0.52 0.15 0.08 0.02 0.00 0.00 175.26 176.08 1lud s VAL 157 N -1.56 -0.24 0.31 2.63 1.01 -0.07 -2.13 120.40 120.35 1lud s VAL 157 Ca 0.30 0.33 0.10 0.00 0.00 0.00 0.00 61.98 62.70 1lud s VAL 157 Cb -0.11 -0.30 -0.05 0.00 0.00 0.00 0.00 36.38 35.91 1lud s VAL 157 CO 0.22 0.12 -0.07 0.26 0.00 0.00 0.00 175.10 175.64 1lud s TRP 158 N 2.28 2.48 0.01 5.22 0.52 0.20 0.09 118.94 129.74 1lud s TRP 158 Ca 0.03 -0.38 0.01 0.00 0.02 0.00 0.00 56.10 55.79 1lud s TRP 158 Cb -0.12 -1.28 -0.01 0.00 -1.15 0.00 0.00 33.47 30.91 1lud s TRP 158 CO -0.06 0.59 -0.03 -0.65 0.02 0.00 0.00 176.95 176.82 1lud s GLN 159 N -3.63 0.27 0.04 4.98 -0.21 -0.64 -1.32 119.66 119.14 1lud s GLN 159 Ca 0.32 -0.26 -0.30 0.00 0.02 0.00 0.00 55.36 55.14 1lud s GLN 159 Cb -0.02 -0.17 -0.05 0.00 1.00 0.00 0.00 33.01 33.76 1lud s GLN 159 CO 0.18 0.04 1.21 0.21 -2.12 0.00 0.00 175.29 174.81 1lud s LYS 160 N -0.48 4.41 0.51 2.91 2.20 -1.00 -2.64 119.74 125.66 1lud s LYS 160 Ca -0.03 1.76 -0.20 0.00 -0.36 0.00 0.00 55.97 57.14 1lud s LYS 160 Cb -0.04 -3.40 -0.07 0.00 -1.51 0.00 0.00 37.83 32.82 1lud s LYS 160 CO -0.00 -0.31 1.09 0.15 -0.36 0.00 0.00 175.35 175.92 1lud s LYS 161 N 1.34 3.59 0.00 4.03 -0.14 -1.24 -5.01 119.74 122.30 1lud s LYS 161 Ca 0.58 1.50 0.00 0.00 -1.36 0.00 0.00 55.97 56.69 1lud s LYS 161 Cb -0.29 -2.06 0.00 0.00 -1.68 0.00 0.00 37.83 33.80 1lud s LYS 161 CO 0.28 -0.63 0.00 0.00 -0.76 0.00 0.00 175.35 174.23